# generated using pymatgen
data_Ca3La2Yb5Ir4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.56567273
_cell_length_b   8.50702015
_cell_length_c   7.45788520
_cell_angle_alpha   83.20001414
_cell_angle_beta   83.45710713
_cell_angle_gamma   45.40319169
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3La2Yb5Ir4
_chemical_formula_sum   'Ca3 La2 Yb5 Ir4'
_cell_volume   383.88021175
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ca  Ca0  1  0.79294596  0.64705084  0.67679654  1.0
  Ca  Ca1  1  0.64759745  0.79304041  0.17672196  1.0
  Ca  Ca2  1  0.20833005  0.35081701  0.32438409  1.0
  La  La3  1  0.56708601  0.43126039  0.75041766  1.0
  La  La4  1  0.43122621  0.56962835  0.24894218  1.0
  Yb  Yb5  1  0.02106172  0.80611425  0.91450756  1.0
  Yb  Yb6  1  0.19123023  0.98084384  0.58677303  1.0
  Yb  Yb7  1  0.97853987  0.19567249  0.08415281  1.0
  Yb  Yb8  1  0.81002280  0.01925095  0.41284171  1.0
  Yb  Yb9  1  0.35498565  0.20677852  0.82587569  1.0
  Ir  Ir10  1  0.17879680  0.61106024  0.57976156  1.0
  Ir  Ir11  1  0.38218755  0.83014290  0.92267258  1.0
  Ir  Ir12  1  0.82221197  0.38255315  0.42271896  1.0
  Ir  Ir13  1  0.61377771  0.17578765  0.07343466  1.0